SCHEMBL28746641

SCHEMBL28746641

CCC(C)(C)C(=O)C(=O)N1CCCCC1OC(=S)CCCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 13/20 0.62

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27571761 0.97 FKBP1A (0.61) FKBP1A
SCHEMBL27552088 0.88 FKBP1A (0.59) FKBP1A
SCHEMBL27552192 0.85 FKBP1A (0.61) FKBP1A
SCHEMBL27552125 0.82 FKBP1A (0.60) FKBP1A
SCHEMBL4678705 0.79 FKBP1A (0.82) FKBP1A
SCHEMBL5700640 0.79 FKBP1A (0.67) FKBP1A
SCHEMBL4680565 0.78 FKBP1A (0.78) FKBP1A
SCHEMBL6100689 0.78 FKBP1A (0.72) FKBP1A
SCHEMBL7395654 0.78 FKBP1A (0.68) FKBP1A
SCHEMBL5700650 0.78 FKBP1A (0.66) FKBP1A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1336930-A Bridged heterocyclic derivatives GPINIL HOLDING CORP (US) 2002-02-20 CN disclosed